(2S)-6-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-2-phenyl-2,3-dihydrothiopyran-4-one

Systemtic Name: (2S)-6-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-2-phenyl-2,3-dihydrothiopyran-4-one Openeye Name: (2S)-6-[2-(3-nitrophenyl)-2-oxo-ethyl]sulfanyl-2-phenyl-2,3-dihydrothiopyran-4-one CAS Name: (2S)-6-[[2-(3-nitrophenyl)-2-oxoethyl]thio]-2-phenyl-2,3-dihydrothiopyran-4-one IUPAC Name: (2S)-6-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-2-phenyl-2,3-dihydrothiopyran-4-one Traditional Name: (2S)-6-[[2-keto-2-(3-nitrophenyl)ethyl]thio]-2-phenyl-2,3-dihydrothiopyran-4-one Formula: C19H15NO4S2 MolecularWeight: 385.4567

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(=CC1=O)SCC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1[C@H](SC(=CC1=O)SCC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H15NO4S2/c21-16-10-18(13-5-2-1-3-6-13)26-19(11-16)25-12-17(22)14-7-4-8-15(9-14)20(23)24/h1-9,11,18H,10,12H2/t18-/m0/s1